Chemical Properties of 5-«beta»-cholestan-3«alpha»-ol, formate

InChI

InChI=1S/C28H48O2/c1-19(2)7-6-8-20(3)24-11-12-25-23-10-9-21-17-22(30-18-29)13-15-27(21,4)26(23)14-16-28(24,25)5/h18-26H,6-17H2,1-5H3

InChI Key

CPSQZDFMYGLDLH-UHFFFAOYSA-N

Formula

C28H48O2

SMILES

CC(C)CCCC(C)C1CCC2C3CCC4CC(OC=O)CCC4(C)C3CCC12C

Molecular Weight¹

416.68

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• P_c : Critical Pressure (kPa).
• I_np : Non-polar retention indices.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1393.13; 1589.59]	J/mol×K	[940.35; 1164.45]
Cp,gas	1393.13	J/mol×K	940.35	Joback Calculated Property
Cp,gas	1424.57	J/mol×K	977.70	Joback Calculated Property
Cp,gas	1456.12	J/mol×K	1015.05	Joback Calculated Property
Cp,gas	1488.08	J/mol×K	1052.40	Joback Calculated Property
Cp,gas	1520.77	J/mol×K	1089.75	Joback Calculated Property
Cp,gas	1554.50	J/mol×K	1127.10	Joback Calculated Property
Cp,gas	1589.59	J/mol×K	1164.45	Joback Calculated Property

Similar Compounds

Find more compounds similar to 5-«beta»-cholestan-3«alpha»-ol, formate.

Sources

• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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